2,3-dimethyl benzofuran
2,3-dimethylbenzofuran
 
Notes:
Present in coffee and roasted onion. Flavorant
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      3782-00-1 2,3-Dimethylbenzofuran
       
  • Synerzine
    • Synerzine, Inc.
      Innovation. Customization. Aroma Ingredients.
      Synerzine is a leading supplier of flavor and fragrance ingredients.
      Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust.
      Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster.
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      Product(s):
      W0483 2,3-DIMETHYLBENZOFURAN
       
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    Flavor Demo Formulas
CAS Number: 3782-00-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 223-245-7
FDA UNII: IGH41K1QPK
Nikkaji Web: J217.680G
Beilstein Number: 0116665
MDL: MFCD00078708
CoE Number: 11913
XlogP3-AA: 3.10 (est)
Molecular Weight: 146.18890000
Formula: C10 H10 O
NMR Predictor: Predict (works with chrome or firefox)
Category: flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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NCBI: Search
JECFA Food Flavoring: 1495  2,3-dimethylbenzofuran
DG SANTE Food Flavourings: 13.074  2,3-dimethylbenzofuran
FEMA Number: 3535 2,3-dimethylbenzofuran
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):3782-00-1 ; 2,3-DIMETHYLBENZOFURAN
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Physical Properties:
Appearance: pale yellow to yellow clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.03100 to 1.03700 @  25.00 °C.
Pounds per Gallon - (est).: 8.579 to  8.629
Refractive Index: 1.55400 to 1.56300 @  20.00 °C.
Boiling Point: 101.00 to  102.00 °C. @ 19.00 mm Hg
Boiling Point: 96.00 to  98.00 °C. @ 15.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure: 0.101000 mmHg @ 25.00 °C. (est)
Flash Point: 187.00 °F. TCC ( 86.11 °C. )
logP (o/w): 3.480 (est)
Soluble in:
 alcohol
 water, 62.2 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: phenolic
 
Odor Strength: high ,
recommend smelling in a 1.00 % solution or less
 
 chemical  phenolic  smoky  tobacco  
Odor Description:
at 1.00 % in dipropylene glycol. 
chemical phenolic smoke tobacco
 
 chemical  resinous  phenolic  smoky  tobacco  pungent  licorice black licorice  leathery  smoky  bacon  meaty  
Odor Description:
at 1.00 %.  
Chemical tar-like, phenolic, smoky, tobacco, slightly pungent with a hint of black licorice drops, leather, cade oil and smoky bacon meaty
Mosciano, Gerard, P&F No. 5th ed., 30, 48, (2005)
 
 
Flavor Type: chemical
 
 chemical  burnt  woody  coumarinic  tobacco  whiskey  fusel  resinous  
Taste Description:
at 2.00 ppm.  
Chemical, burnt woody, coumarin-like, tobacco, whiskey and slightly fusel like, tarry with a lingering aftertaste
Mosciano, Gerard, P&F No. 5th ed., 30, 48, (2005)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Axsyn
For experimental / research use only.
Benzofuran,2,3-dimethyl-
BOC Sciences
For experimental / research use only.
2,3-Dimethylbenzofuran
Carbosynth
For experimental / research use only.
2,3-Dimethylbenzofuran
Parchem
2,3-dimethyl benzofuran
Synerzine
2,3-DIMETHYLBENZOFURAN
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for 2,3-dimethyl benzofuran usage levels up to:
  0.0500 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.52 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.01 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 160 (μg/person/day)
Threshold of Concern:90 (μg/person/day)
Structure Class: III
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 11
Click here to view publication 11
 average usual ppmaverage maximum ppm
baked goods: -2.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: -1.00000
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: -1.00000
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: -1.00000
snack foods: --
soft candy: --
soups: -1.00000
sugar substitutes: --
sweet sauces: --
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 0.43000-
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 0.500001.40000
Edible ices, including sherbet and sorbet (03.0): 0.17000-
Processed fruit (04.1): --
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 0.017000.04300
Chewing gum (05.0): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): --
Bakery wares (07.0): --
Meat and meat products, including poultry and game (08.0): --
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): --
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 0.43000-
Foodstuffs intended for particular nutritional uses (13.0): --
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 0.230001.40000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 0.540002.90000
Ready-to-eat savouries (15.0): --
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): --
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Safety References:
European Food Safety Athority(EFSA): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Flavouring Group Evaluation 67 (FGE.67): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 67, Revision 1 (FGE.67Rev.1): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 67 Revision 2 (FGE.67Rev2): Consideration of 28 furan-substituted compounds evaluated by JECFA at the 55th, 65th and 69th meetings (JECFA, 2001, 2006a, 2009b)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 67, Revision 3 (FGE.67Rev3): consideration of 23 furan-substituted compounds evaluated by JECFA at the 55th, 65th, 69th and 86th meetings
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 3782-00-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 2734646
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 2,3-dimethyl-1-benzofuran
Chemidplus: 0003782001
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References:
 2,3-dimethyl-1-benzofuran
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 3782-00-1
Pubchem (cid): 2734646
Pubchem (sid): 135263714
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS): View
HMDB (The Human Metabolome Database): HMDB33176
FooDB: FDB011186
Export Tariff Code: 2932.19.0000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
EFSA Update of results on the monitoring of furan levels in food: Read Report
EFSA Previous report: Results on the monitoring of furan levels in food: Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food: Read Report
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Potential Blenders and core components note
 
For Odor
amber
amber
 ambrette seed absoluteFL/FR
animal
isobutyl quinolineFR
2-isobutyl quinolineFR
isobutyl quinolineFR
6-tert-butyl-meta-cresolFL/FR
 castoreum resinoidFL/FR
 castoreum resinoid replacerFR
 leather fragranceFR
6-methyl quinolineFL/FR
anise
 anise seed oilFL/FR
star anise seed oil chinaFL/FR
 anise seed oil colombiaFL/FR
star anise seed oil spainFL/FR
balsamic
 amyl phenyl acetateFL/FR
sumatra benzoin absoluteFL/FR
siam benzoin CO2 extractFL/FR
 benzoin essenceFR
 guaiacyl phenyl acetateFL/FR
cereal
 bran absoluteFR
chocolate
 vanillyl ethyl etherFL/FR
coffee
 furfuryl mercaptanFL/FR
floral
alpha-amyl cinnamyl acetateFL/FR
 boronia butenalFR
 cananga oilFL/FR
 cananga oil chinaFL/FR
 citronellolFL/FR
delta-damasconeFL/FR
 dimethyl octanolFL/FR
 floral methanolFR
 orris pyridine 25% IPMFR
 tobacco flower absoluteFR
fruity
alpha-amyl cinnamyl isovalerateFL/FR
 cyclohexanone diethyl acetalFL/FR
(Z)-beta-damasconeFL/FR
(E)-beta-damasconeFL/FR
beta-damasconeFL/FR
 ethyl 3-hydroxyhexanoateFL/FR
 leather propionateFR
 osmanthus flower absoluteFL/FR
fungal
 methyl 2-furoateFL/FR
green
3,7-dimethyl-6-octenoic acidFL/FR
 oakmoss oilFR
 phenoxyacetaldehyde 50% in benzyl alcoholFR
 yerba mate leaf oilFL/FR
hay
 beeswax absoluteFL/FR
 hay absoluteFR
 tobacco leaf absoluteFL/FR
 woodruff absoluteFR
herbal
 cananga fruit oilFR
 matricaria chamomilla flower oilFL/FR
 methyl nicotinateFL/FR
 saffron indenoneFL/FR
 safranalFL/FR
 theaspiraneFL/FR
 thyme undecaneFR
gamma-valerolactoneFL/FR
 yerba mate absoluteFL/FR
honey
 phenyl acetic acidFL/FR
leathery
4-tert-butyl phenolCS
 castoreum absoluteFL/FR
 leather cyclohexanolFR
russian leather fragranceFR
 leather specialtyFR
russian leather specialtyFR
marine
 marine pyridineFR
musty
ketoisophoroneFL/FR
nutty
2,3-dimethyl pyrazineFL/FR
orris
2(1)-orris butanalFL/FR
phenolic
 betel leaf oil replacerFR
meta-cresolFR
ortho-guaiacolFL/FR
2'-hydroxyacetophenoneFL/FR
4-methyl-2,6-dimethoxyphenolFL/FR
 piper betle leaf oilFR
2-propyl phenolFL/FR
2-isopropyl phenolFL/FR
2,5-xylenolFL/FR
popcorn
2-acetyl pyridineFL/FR
pungent
 naphthaleneFR
smoky
 beech wood creosoteFL/FR
 birch tar oilFL/FR
 cade oilFR
2,6-dimethoxyphenolFL/FR
alpha-ethoxy-ortho-cresolFL/FR
4-ethyl phenolFL/FR
 phoebe oil brazil 
 propyl parabenCS
 pyroligneous acidsFL/FR
 pyroligneous acids hickoryFL/FR
spicy
 cananga leaf oilFR
 cubeb oilFL/FR
 cuminyl alcoholFL/FR
N,N-diethyl octanamideFR
4-ethyl guaiacolFL/FR
4-methyl guaiacolFL/FR
 pepper tree berry oilFL/FR
tobacco
para-cresyl isovalerateFL/FR
3-ethyl pyridineFL/FR
 methyl benzoxoleFL/FR
 tobacco concreteFR
(E,E/E,Z)-tobacco cyclohexenoneFL/FR
 veltonal (Bedoukian)FR
tonka
 deertongue absoluteFR
gamma-hexalactoneFL/FR
 mint lactoneFL/FR
 saffron resinoidFL/FR
 tonka undecanoneFR
 whiskey lactoneFL/FR
tropical
 genet absoluteFL/FR
vanilla
 ethyl vanillin hexylene glycol acetalFR
 propenyl guaetholFL/FR
woody
 amber decatrieneFR
alpha-cedrene epoxideFR
 guaiacyl acetateFL/FR
isolongifolene ketoneFR
 methyl cedryl ketoneFL/FR
 tobacarol (IFF)FR
 tobacco noneneFR
 woody dioxolaneFR
 woody etherFR
 
For Flavor
 
No flavor group found for these
 amyl phenyl acetateFL/FR
 benzyl disulfideFL
 birch tar oilFL/FR
6-tert-butyl-meta-cresolFL/FR
 capsicum oleoresinFL
 cyclohexanone diethyl acetalFL/FR
2,6-dimethoxy-4-vinyl phenolFL
alpha-ethoxy-ortho-cresolFL/FR
 fig leaf absoluteFL
2-furfurylidene butyraldehydeFL
 methyl nicotinateFL/FR
1-methyl pyrroleFL
2(1)-orris butanalFL/FR
 phoebe oil brazil 
 prenyl mercaptanFL
2-propyl phenolFL/FR
2-propyl pyridineFL
 yerba mate leaf oilFL/FR
beta-damasconeFL/FR
animal
 castoreum resinoidFL/FR
6-methyl quinolineFL/FR
anise
 anise seed oilFL/FR
star anise seed oil chinaFL/FR
 anise seed oil colombiaFL/FR
star anise seed oil spainFL/FR
brown
 beeswax absoluteFL/FR
burnt
 bacon dithiazineFL
caramellic
3-ethyl pyridineFL/FR
 methyl 2-furoateFL/FR
citrus
ketoisophoroneFL/FR
coffee
 furfuryl mercaptanFL/FR
cooling
 theaspiraneFL/FR
corn
2-acetyl pyridineFL/FR
creamy
gamma-hexalactoneFL/FR
 mint lactoneFL/FR
earthy
alpha-amyl cinnamyl acetateFL/FR
fatty
 dimethyl octanolFL/FR
floral
 cananga oilFL/FR
 cananga oil chinaFL/FR
 citronellolFL/FR
3,7-dimethyl-6-octenoic acidFL/FR
 phenyl acetic acidFL/FR
fruity
alpha-amyl cinnamyl isovalerateFL/FR
(E)-beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
 ethyl 3-hydroxyhexanoateFL/FR
 osmanthus flower absoluteFL/FR
grassy
 tobacco leaf absoluteFL/FR
hay
 genet absoluteFL/FR
herbal
 clover herb distillate (melilotus officinalis)FL
 matricaria chamomilla flower oilFL/FR
 saffron indenoneFL/FR
 yerba mate absoluteFL/FR
leathery
 castoreum absoluteFL/FR
meaty
4-allyl-2,6-dimethoxyphenolFL
ortho-thioguaiacolFL
medicinal
2,6-dimethoxyphenolFL/FR
musty
2,5-xylenolFL/FR
naphthyl
2'-hydroxyacetophenoneFL/FR
nutty
2,3-dimethyl pyrazineFL/FR
 methyl benzoxoleFL/FR
(E,E/E,Z)-tobacco cyclohexenoneFL/FR
onion
2-methyl-1,3-dithiolaneFL
phenolic
para-cresyl isovalerateFL/FR
 guaiacyl phenyl acetateFL/FR
4-methyl-2,6-dimethoxyphenolFL/FR
rummy
 vanillyl ethyl etherFL/FR
smoky
 beech wood creosoteFL/FR
4-ethyl phenolFL/FR
 pyroligneous acidsFL/FR
 pyroligneous acids hickoryFL/FR
dextro-xyloseFL
solvent
2-isopropyl phenolFL/FR
spicy
sumatra benzoin absoluteFL/FR
siam benzoin CO2 extractFL/FR
 chipotle chili oleoresinFL
 cubeb oilFL/FR
 cuminyl alcoholFL/FR
4-methyl guaiacolFL/FR
 paprika oleoresinFL
 pepper tree berry oilFL/FR
sweet
 saffron resinoidFL/FR
tonka
gamma-valerolactoneFL/FR
vanilla
 propenyl guaetholFL/FR
woody
 ambrette seed absoluteFL/FR
delta-damasconeFL/FR
4-ethyl guaiacolFL/FR
ortho-guaiacolFL/FR
 guaiacyl acetateFL/FR
 methyl cedryl ketoneFL/FR
 safranalFL/FR
 whiskey lactoneFL/FR
 
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Potential Uses:
 chocolateFL
 coffeeFL
 leatherFR
 smokeFL
 tobaccoFR
 tonka beanFR
 vanillaFL
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Occurrence (nature, food, other): note
 cade oil
Search Trop  Picture
 coffee roasted coffee
Search  PMC Picture
 onion roasted onion
Search Trop  Picture
 tobacco latakia tobacco
Search  Picture
Synonyms   Articles   Notes   Search   Top
Synonyms:
 benzofuran, 2,3-dimethyl-
2,3-dimethyl-1-benzofuran
 dimethylbenzofuran
2,3-dimethylbenzofuran
2,3-dimethylcoumarone
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